Verongidoic acid; (5S,10R)-form, (4-Carboxybutyl)amide
AlkaPlorer ID: AK317514
Synonym: Homopurpuroceratic acid B
IUPAC Name: 5-[(7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carbonyl)amino]pentanoic acid
Structure
SMILES: COC1=C(Br)C(O)C2(C=C1Br)CC(C(=O)NCCCCC(=O)O)=NO2
InChI: InChI=1S/C15H18Br2N2O6/c1-24-12-8(16)6-15(13(22)11(12)17)7-9(19-25-15)14(23)18-5-3-2-4-10(20)21/h6,13,22H,2-5,7H2,1H3,(H,18,23)(H,20,21)
InChIKey: SIZQPOHDGICIRV-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudovibrio denitrificans | Pseudovibrio | Stappiaceae | Hyphomicrobiales | Alphaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 482.12500000000034
TPSA？: 117.45
MolLogP？: 1.7788000000000002
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|